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Ligand

NameCHEMBL459724
Molecular formulaC20H20BrN3O2
IUPAC name(3S,4R)-N-[(E)-1-(3-bromophenyl)ethylideneamino]-N-methyl-2-oxo-4-phenylpyrrolidine-3-carboxamide
Molecular weight414.303
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50412710
Inchi KeyGAWDAEQJMOURHQ-SGASUCAWSA-N
Inchi IDInChI=1S/C20H20BrN3O2/c1-13(15-9-6-10-16(21)11-15)23-24(2)20(26)18-17(12-22-19(18)25)14-7-4-3-5-8-14/h3-11,17-18H,12H2,1-2H3,(H,22,25)/b23-13+/t17-,18-/m0/s1
PubChem CID25108341
ChEMBLCHEMBL459724
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
91963Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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